Diffusion-influenced reactions in a hollow nano-reactor with a circular hole

被引:7
|
作者
Piazza, Francesco [1 ,2 ]
Traytak, Sergey D. [3 ,4 ]
机构
[1] Univ Orleans, Chateau Source, F-45100 Orleans, France
[2] CNRS, Ctr Biophys Mol, UPR4301, F-45071 Orleans, France
[3] Le STUDIUM, F-45071 Orleans, France
[4] RAS, Semenov Inst Chem Phys, Moscow 117977, Russia
关键词
NARROW ESCAPE PROBLEM; YOLK-SHELL NANOPARTICLES; DRUG-DELIVERY; LIMITED REACTIONS; NANOREACTORS; NANOSPHERES; GEOMETRIES; KINETICS; CARRIERS; ENZYMES;
D O I
10.1039/c4cp05605a
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
\Hollow nanostructures are paid increasing attention in many nanotechnology-related communities in view of their numerous applications in chemistry and biotechnology, e.g. as smart nanoreactors or drug-delivery systems. In this paper we consider irreversible, diffusion-influenced reactions occurring within a hollow spherical cavity endowed with a circular hole on its surface. Importantly, our model is not limited to small sizes of the aperture. In our scheme, reactants can freely diffuse inside and outside the cavity through the hole, and react at a spherical boundary of given size encapsulated in the chamber and endowed with a given intrinsic rate constant. We work out the solution of the above problem, enabling one to compute the reaction rate constant to any desired accuracy. Remarkably, we show that, in the case of narrow holes, the rate constant is extremely well-approximated by a simple formula that can be derived on the basis of simple physical arguments and that can be readily employed to analyze experimental data.
引用
收藏
页码:10417 / 10425
页数:9
相关论文
共 50 条
  • [1] DIFFUSION-INFLUENCED REACTIONS
    CUKIER, RI
    JOURNAL OF STATISTICAL PHYSICS, 1986, 42 (1-2) : 69 - 82
  • [2] STOCHASTICALLY GATED DIFFUSION-INFLUENCED REACTIONS
    SZABO, A
    SHOUP, D
    NORTHRUP, SH
    MCCAMMON, JA
    JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (09): : 4484 - 4493
  • [3] THEORY OF REVERSIBLE DIFFUSION-INFLUENCED REACTIONS
    AGMON, N
    SZABO, A
    JOURNAL OF CHEMICAL PHYSICS, 1990, 92 (09): : 5270 - 5284
  • [4] FLUCTUATION AND ROTATION IN DIFFUSION-INFLUENCED MONOMOLECULAR REACTIONS
    BASHFORD, D
    JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (12): : 6999 - 7010
  • [5] Memory equations for kinetics of diffusion-influenced reactions
    Department of Chemistry, Basic Sciences Research Institute, Chungbuk National University, Cheongju 361-763, Korea, Republic of
    Bull. Korean Chem. Soc., 2006, 10 (1659-1663):
  • [6] Theory of diffusion-influenced reactions in complex geometries
    Galanti, Marta
    Fanelli, Duccio
    Traytak, Sergey D.
    Piazza, Francesco
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 18 (23) : 15950 - 15954
  • [7] Diffusion-influenced kinetics of reactions involving polymers
    Sung, J
    Park, PJ
    Lee, J
    Lee, W
    Kim, JH
    Lee, S
    BULLETIN OF THE KOREAN CHEMICAL SOCIETY, 2003, 24 (06) : 843 - 852
  • [8] The intrinsic rate constants in diffusion-influenced reactions
    Vijaykumar, Adithya
    Bolhuis, Peter G.
    ten Wolde, Pieter Rein
    FARADAY DISCUSSIONS, 2016, 195 : 421 - 441
  • [9] Memory equations for kinetics of diffusion-influenced reactions
    Yang, Mino
    BULLETIN OF THE KOREAN CHEMICAL SOCIETY, 2006, 27 (10) : 1659 - 1663
  • [10] Computational methods for diffusion-influenced biochemical reactions
    Dobrzynski, Maciej
    Rodriguez, Jordi Vidal
    Kaandorp, Jaap A.
    Blom, Joke G.
    BIOINFORMATICS, 2007, 23 (15) : 1969 - 1977